ATOM 37
1 C1y C 25.9410 -19.6025
2 C5x C 27.1054 -18.9320
3 N1x N 28.2628 -19.5954
4 C1y C 29.4200 -18.9249
5 C1b C 30.5843 -19.5883
6 C8y C 31.7416 -18.9180
7 C8x C 25.4414 -14.7087
8 C8y C 25.4414 -16.0493
9 C8x C 26.6049 -16.7198
10 C8x C 27.7684 -16.0493
11 C8y C 27.7684 -14.7087
12 C8x C 26.6049 -14.0382
13 C2x C 28.9295 -14.0392
14 O2x O 24.2811 -16.7203
15 C1y C 24.2818 -18.6468
16 C2x C 30.5977 -14.9998
17 N1x N 30.5950 -16.9232
18 C5x C 29.4169 -17.5843
19 O5x O 27.1023 -17.5914
20 O5x O 28.2604 -16.8997
21 N1b N 25.9422 -20.9431
22 C1c C 23.1102 -19.3214
23 C5a C 27.1104 -21.6126
24 C1y C 27.1115 -22.9604
25 O5a O 28.2706 -20.9413
26 C8x C 32.8941 -19.5890
27 C8x C 34.0584 -18.9186
28 C8x C 34.0567 -17.5807
29 C8x C 32.8907 -16.9061
30 C8x C 31.7334 -17.5836
31 N1y N 26.0313 -23.7464
32 C1x C 26.4430 -25.0255
33 C1x C 27.7908 -25.0942
34 C1x C 28.2003 -23.7445
35 C1a C 24.8627 -23.0708
36 C1a C 21.9487 -18.6524
37 C1a C 23.1117 -20.6622
BOND 40
1 7 8 1
2 2 19 2
3 8 9 2
4 18 20 2
5 9 10 1
6 1 21 1 #Up
7 10 11 2
8 15 22 1 #Down
9 11 12 1
10 21 23 1
11 12 7 2
12 24 23 1 #Down
13 1 2 1
14 23 25 2
15 11 13 1
16 3 4 1
17 8 14 1
18 14 15 1
19 6 26 2
20 26 27 1
21 27 28 2
22 28 29 1
23 29 30 2
24 30 6 1
25 4 5 1 #Down
26 13 16 2
27 15 1 1
28 2 3 1
29 24 31 1
30 31 32 1
31 32 33 1
32 33 34 1
33 34 24 1
34 16 17 1
35 31 35 1
36 5 6 1
37 22 36 1
38 4 18 1
39 22 37 1
40 18 17 1
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